2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane

C136H102B2N4O7PtS4 — CID 159747870

IUPAC2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane
SMILESCC1(C)OB(c2cc(Oc3cc(B4OC(C)(C)C(C)(C)O4)cc(-c4ccccc4)c3)cc(-c3ccccc3)c2)OC1(C)C.[Pt+2].[c-]1c(Oc2[c-]c(-c3nccc4cc(-c5ccccc5)sc34)cc(-c3ccccc3)c2)cc(-c2ccccc2)cc1-c1nccc2cc(-c3ccccc3)sc12.c1ccc(-c2cc(Oc3cc(-c4ccccc4)cc(-c4nccc5cc(-c6ccccc6)sc45)c3)cc(-c3nccc4cc(-c5ccccc5)sc34)c2)cc1
InChIInChI=1S/C50H32N2OS2.C50H30N2OS2.C36H40B2O5.Pt/c2*1-5-13-33(14-6-1)39-25-41(47-49-37(21-23-51-47)31-45(54-49)35-17-9-3-10-18-35)29-43(27-39)53-44-28-40(34-15-7-2-8-16-34)26-42(30-44)48-50-38(22-24-52-48)32-46(55-50)36-19-11-4-12-20-36;1-33(2)34(3,4)41-37(40-33)29-19-27(25-15-11-9-12-16-25)21-31(23-29)39-32-22-28(26-17-13-10-14-18-26)20-30(24-32)38-42-35(5,6)36(7,8)43-38;/h1-32H;1-28,31-32H;9-24H,1-8H3;/q;-2;;+2
InChIKeyBBAJJKLGSGMURS-UHFFFAOYSA-N
MW2249.30 g/mol
LogP36.41
Rot. Bonds22

About 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane

2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane (PubChem CID 159747870) has the molecular formula C136H102B2N4O7PtS4 and a molecular weight of 2249.30 g/mol. Its IUPAC name is 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane.

Molecular Properties

Compound Name2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane
PubChem CID159747870
Molecular FormulaC136H102B2N4O7PtS4
Molecular Weight2249.30 g/mol
Exact Mass2247.65
IUPAC Name2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane
SMILESCC1(C)OB(c2cc(Oc3cc(B4OC(C)(C)C(C)(C)O4)cc(-c4ccccc4)c3)cc(-c3ccccc3)c2)OC1(C)C.[Pt+2].[c-]1c(Oc2[c-]c(-c3nccc4cc(-c5ccccc5)sc34)cc(-c3ccccc3)c2)cc(-c2ccccc2)cc1-c1nccc2cc(-c3ccccc3)sc12.c1ccc(-c2cc(Oc3cc(-c4ccccc4)cc(-c4nccc5cc(-c6ccccc6)sc45)c3)cc(-c3nccc4cc(-c5ccccc5)sc34)c2)cc1
InChIInChI=1S/C50H32N2OS2.C50H30N2OS2.C36H40B2O5.Pt/c2*1-5-13-33(14-6-1)39-25-41(47-49-37(21-23-51-47)31-45(54-49)35-17-9-3-10-18-35)29-43(27-39)53-44-28-40(34-15-7-2-8-16-34)26-42(30-44)48-50-38(22-24-52-48)32-46(55-50)36-19-11-4-12-20-36;1-33(2)34(3,4)41-37(40-33)29-19-27(25-15-11-9-12-16-25)21-31(23-29)39-32-22-28(26-17-13-10-14-18-26)20-30(24-32)38-42-35(5,6)36(7,8)43-38;/h1-32H;1-28,31-32H;9-24H,1-8H3;/q;-2;;+2
InChIKeyBBAJJKLGSGMURS-UHFFFAOYSA-N
XLogP36.41
TPSA116.17 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds22
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002249.30
LogP ≤ 536.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane with MolForge

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Related Compounds

8-[8-([1]Benzothiolo[3,2-b]pyridin-8-yl)dibenzothiophen-2-yl]oxy-[1]benzothiolo[3,2-b]pyridine
CID 90250479
2-(2,6-Dimethylphenyl)-7-[3-[3-[2-(2,6-dimethylphenyl)thieno[2,3-c]pyridin-7-yl]-5-phenylphenoxy]-5-phenylphenyl]thieno[2,3-c]pyridine
CID 137538075
2-Phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine
CID 137538115
2-(4-Tert-butylphenyl)-7-[3-[3-[2-(4-tert-butylphenyl)thieno[2,3-c]pyridin-7-yl]-5-(5-methylthiophen-2-yl)phenoxy]-5-(5-methylthiophen-2-yl)phenyl]thieno[2,3-c]pyridine
CID 137538122
5-(6-But-2-ynoxynaphthalen-2-yl)-5-[5-[tris[5-[5-(6-but-2-ynoxynaphthalen-2-yl)indeno[1,2-b]pyridin-5-yl]thiophen-2-yl]methyl]thiophen-2-yl]indeno[1,2-b]pyridine
CID 153299520
5-Propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1-benzothiophene;3-propan-2-yl-1-benzothiophene;6-propan-2-yl-2,3-dihydro-1,4-benzodioxine;bis(3-propan-2-ylpyridine);3-propan-2-ylquinoline;6-propan-2-ylquinoline;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 157346048
2-(3H-dibenzothiophen-3-id-4-yl)-4-phenylpyridine;4,5-dimethyl-2-phenylpyridine;3-(9,9-dimethyl-3H-xanthen-3-id-4-yl)-[1]benzothiolo[2,3-c]pyridine;2-(9,9-dimethyl-2H-xanthen-2-id-1-yl)pyridine;2-(9,9-dimethyl-3H-xanthen-3-id-2-yl)pyridine;3-(9,9-diphenyl-3H-xanthen-3-id-4-yl)-9,9-dimethyl-8,8a-dihydroindeno[2,1-c]pyridine;tetrakis(iridium);2-(8-phenyl-3H-dibenzothiophen-3-id-4-yl)pyridine;2-phenylpyridine
CID 157381603
4,5-dimethyl-2-phenylpyridine;3-(9,9-dimethyl-3H-xanthen-3-id-4-yl)-[1]benzothiolo[2,3-c]pyridine;2-(9,9-dimethyl-3H-xanthen-3-id-2-yl)pyridine;3-(9,9-diphenyl-3H-xanthen-3-id-4-yl)-9,9-dimethyl-8,8a-dihydroindeno[2,1-c]pyridine;tris(iridium);2-(8-phenyl-3H-dibenzothiophen-3-id-4-yl)pyridine;2-phenylpyridine
CID 157573381
2-[3-Bromo-5-[3-bromo-5-(5-methylthiophen-2-yl)phenoxy]phenyl]-5-methylthiophene;2-(3-bromo-5-iodophenyl)-5-methylthiophene;2-(3-bromo-5-methoxyphenyl)-5-methylthiophene;3-bromo-5-(5-methylthiophen-2-yl)phenol;2-(4-tert-butylphenyl)-7-[3-[3-[2-(4-tert-butylphenyl)thieno[2,3-c]pyridin-7-yl]-5-(5-methylthiophen-2-yl)benzene-2-id-1-yl]oxy-5-(5-methylthiophen-2-yl)benzene-2-id-1-yl]thieno[2,3-c]pyridine;2-(4-tert-butylphenyl)-7-[3-[3-[2-(4-tert-butylphenyl)thieno[2,3-c]pyridin-7-yl]-5-(5-methylthiophen-2-yl)phenoxy]-5-(5-methylthiophen-2-yl)phenyl]thieno[2,3-c]pyridine;1,3-dibromo-5-iodobenzene;2-(3,5-dibromophenyl)-5-methylthiophene;platinum(2+);4,4,5,5-tetramethyl-2-[3-(5-methylthiophen-2-yl)-5-[3-(5-methylthiophen-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane
CID 157987204
CID 158294691
CID 158294691
CID 160300621
CID 160300621
Bis(chloroplatinum(1+));5-[5-[3,4-dibutyl-5-(5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2-[3-[5-[5-[3,4-dibutyl-5-(5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2-pyridinyl]benzene-2-id-1-yl]pyridine;5-[5-[3,4-dimethyl-5-(7-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2-[3-[5-[5-[3,4-dimethyl-5-(7-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)thiophen-2-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]-2-pyridinyl]benzene-2-id-1-yl]pyridine;methane
CID 160885070

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane?
The IUPAC name of 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane (CID 159747870) is 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane.
What is the SMILES notation for 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane?
The canonical SMILES for 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane is CC1(C)OB(c2cc(Oc3cc(B4OC(C)(C)C(C)(C)O4)cc(-c4ccccc4)c3)cc(-c3ccccc3)c2)OC1(C)C.[Pt+2].[c-]1c(Oc2[c-]c(-c3nccc4cc(-c5ccccc5)sc34)cc(-c3ccccc3)c2)cc(-c2ccccc2)cc1-c1nccc2cc(-c3ccccc3)sc12.c1ccc(-c2cc(Oc3cc(-c4ccccc4)cc(-c4nccc5cc(-c6ccccc6)sc45)c3)cc(-c3nccc4cc(-c5ccccc5)sc34)c2)cc1.
What is the InChIKey of 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane?
The InChIKey is BBAJJKLGSGMURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N2OS2.C50H30N2OS2.C36H40B2O5.Pt/c2*1-5-13-33(14-6-1)39-25-41(47-49-37(21-23-51-47)31-45(54-49)35-17-9-3-10-18-35)29-43(27-39)53-44-28-40(34-15-7-2-8-16-34)26-42(30-44)48-50-38(22-24-52-48)32-46(55-50)36-19-11-4-12-20-36;1-33(2)34(3,4)41-37(40-33)29-19-27(25-15-11-9-12-16-25)21-31(23-29)39-32-22-28(26-17-13-10-14-18-26)20-30(24-32)38-42-35(5,6)36(7,8)43-38;/h1-32H;1-28,31-32H;9-24H,1-8H3;/q;-2;;+2.
What are the key properties of 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane?
2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane has a molecular weight of 2249.30 g/mol, XLogP of 36.41, 22 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]thieno[2,3-c]pyridine;2-phenyl-7-[3-phenyl-5-[3-phenyl-5-(2-phenylthieno[2,3-c]pyridin-7-yl)phenoxy]phenyl]thieno[2,3-c]pyridine;platinum(2+);4,4,5,5-tetramethyl-2-[3-phenyl-5-[3-phenyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]phenyl]-1,3,2-dioxaborolane is sourced from PubChem (CID 159747870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).